SCHEMBL10926329

SCHEMBL10926329

Cc1ccc(Oc2nsnc(Cl)c2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ ALDH1A1 P00352 5/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ MRGPRX1 Q96LB2 1/20 0.36
▸ NPSR1 Q6W5P4 3/20 0.36
▸ HTT P42858 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NPBWR1 P48145 4/20 0.35
▸ MCHR1 Q99705 3/20 0.35
▸ TEAD4 Q15561 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11621874 0.87 MERTK (0.41) MAPK1KMT2AMEN1ALDH1A1POLB
SCHEMBL10924387 0.87 MEN1 (0.39) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL11064204 0.83 NSD2 (0.39) ALDH1A1L3MBTL1HTTKDM4EHPGD
SCHEMBL11623968 0.83 ALDH1A1 (0.43) MAPK1KMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL11621648 0.81 LTA4H (0.44) SMN1; SMN2LMNA
SCHEMBL11468336 0.80 GLA (0.32) MAPK1ALDH1A1HTTNPBWR1SMN1; SMN2
SCHEMBL11620743 0.79 SMN1; SMN2 (0.46) KMT2AMEN1ALDH1A1L3MBTL1POLB
SCHEMBL11473883 0.74 TOP2A (0.48) KMT2AMEN1ALDH1A1L3MBTL1POLB
SCHEMBL11552165 0.74 LMNA (0.44) KMT2AALDH1A1NPSR1HTTKDM4E
SCHEMBL8779443 0.73 ALDH1A1 (0.44) MAPK1KMT2AMEN1ALDH1A1L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4497807-A FUNGICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-02-05 — — US disclosed
US-4097594-A Mono-5-substituted-3-chloro-4H-1,2,6-thiadiazin-4-one antifungal agents FMC CORPORATION (US) 1978-06-27 — — US disclosed
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